[2-(2-methoxy-N-methylanilino)-4-propan-2-yl-1,3-thiazol-5-yl]methanol

C15H20N2O2S — CID 79392784

IUPAC[2-(2-methoxy-N-methylanilino)-4-propan-2-yl-1,3-thiazol-5-yl]methanol
SMILESCOc1ccccc1N(C)c1nc(C(C)C)c(CO)s1
InChIInChI=1S/C15H20N2O2S/c1-10(2)14-13(9-18)20-15(16-14)17(3)11-7-5-6-8-12(11)19-4/h5-8,10,18H,9H2,1-4H3
InChIKeyZREOSPFDHULTCY-UHFFFAOYSA-N
MW292.40 g/mol
LogP3.54
Rot. Bonds5

About [2-(2-methoxy-N-methylanilino)-4-propan-2-yl-1,3-thiazol-5-yl]methanol

[2-(2-methoxy-N-methylanilino)-4-propan-2-yl-1,3-thiazol-5-yl]methanol (PubChem CID 79392784) has the molecular formula C15H20N2O2S and a molecular weight of 292.40 g/mol. Its IUPAC name is [2-(2-methoxy-N-methylanilino)-4-propan-2-yl-1,3-thiazol-5-yl]methanol.

Molecular Properties

Compound Name[2-(2-methoxy-N-methylanilino)-4-propan-2-yl-1,3-thiazol-5-yl]methanol
PubChem CID79392784
Molecular FormulaC15H20N2O2S
Molecular Weight292.40 g/mol
Exact Mass292.12
IUPAC Name[2-(2-methoxy-N-methylanilino)-4-propan-2-yl-1,3-thiazol-5-yl]methanol
SMILESCOc1ccccc1N(C)c1nc(C(C)C)c(CO)s1
InChIInChI=1S/C15H20N2O2S/c1-10(2)14-13(9-18)20-15(16-14)17(3)11-7-5-6-8-12(11)19-4/h5-8,10,18H,9H2,1-4H3
InChIKeyZREOSPFDHULTCY-UHFFFAOYSA-N
XLogP3.54
TPSA45.59 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

[2-[(2-methoxyphenyl)methyl-methylamino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol
CID 79396852
[2-[(4-chlorophenyl)methyl-methylamino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol
CID 79392577
[2-[1-(4-chlorophenyl)ethyl-methylamino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol
CID 79396955
5-bromo-N-(2-methoxyphenyl)-N-methyl-1,3,4-thiadiazol-2-amine
CID 64623493
[2-[(3-chlorophenyl)methyl-methylamino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol
CID 79392645
[2-[(5-chlorothiophen-2-yl)methyl-methylamino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol
CID 79393645
[2-[(2,3-dimethylphenoxy)methyl]-4-propan-2-yl-1,3-thiazol-5-yl]methanol
CID 82434183
[2-(phenylsulfanylmethyl)-4-propan-2-yl-1,3-thiazol-5-yl]methanol
CID 82434317
[2-[methyl(3,3,3-trifluoropropyl)amino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol
CID 79400563
[2-[methyl(pentyl)amino]-4-propan-2-yl-1,3-thiazol-5-yl]methanol
CID 79392570
5-(aminomethyl)-N-(3-methoxyphenyl)-N-methyl-4-propan-2-yl-1,3-thiazol-2-amine
CID 79392583
N-[[2-(2-methoxyphenyl)-4-propan-2-yl-1,3-thiazol-5-yl]methyl]ethanamine
CID 82434874

Frequently Asked Questions

What is the IUPAC name of [2-(2-methoxy-N-methylanilino)-4-propan-2-yl-1,3-thiazol-5-yl]methanol?
The IUPAC name of [2-(2-methoxy-N-methylanilino)-4-propan-2-yl-1,3-thiazol-5-yl]methanol (CID 79392784) is [2-(2-methoxy-N-methylanilino)-4-propan-2-yl-1,3-thiazol-5-yl]methanol.
What is the SMILES notation for [2-(2-methoxy-N-methylanilino)-4-propan-2-yl-1,3-thiazol-5-yl]methanol?
The canonical SMILES for [2-(2-methoxy-N-methylanilino)-4-propan-2-yl-1,3-thiazol-5-yl]methanol is COc1ccccc1N(C)c1nc(C(C)C)c(CO)s1.
What is the InChIKey of [2-(2-methoxy-N-methylanilino)-4-propan-2-yl-1,3-thiazol-5-yl]methanol?
The InChIKey is ZREOSPFDHULTCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2S/c1-10(2)14-13(9-18)20-15(16-14)17(3)11-7-5-6-8-12(11)19-4/h5-8,10,18H,9H2,1-4H3.
What are the key properties of [2-(2-methoxy-N-methylanilino)-4-propan-2-yl-1,3-thiazol-5-yl]methanol?
[2-(2-methoxy-N-methylanilino)-4-propan-2-yl-1,3-thiazol-5-yl]methanol has a molecular weight of 292.40 g/mol, XLogP of 3.54, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-methoxy-N-methylanilino)-4-propan-2-yl-1,3-thiazol-5-yl]methanol is sourced from PubChem (CID 79392784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).